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| Name | Last modified | Size | Description |
|---|---|---|---|---|
| Parent Directory | - | ||
| 0log | 2025-07-19 14:02 | 636 | |
| 1log | 2025-07-19 14:03 | 637 | |
| 2log | 2025-07-19 14:03 | 636 | |
| 3log | 2025-07-19 14:03 | 636 | |
| T0772-super.mol2 | 2025-07-19 14:04 | 6.1K | |
| T0878-super.mol2 | 2025-07-19 14:04 | 5.1K | |
| T2S0223-super.mol2 | 2025-07-19 14:04 | 2.8K | |
| T2S1086-super.mol2 | 2025-07-19 14:04 | 4.1K | |
| T4S0227-super.mol2 | 2025-07-19 14:04 | 2.8K | |
| T4S0692-super.mol2 | 2025-07-19 14:04 | 3.9K | |
| T6S0721-super.mol2 | 2025-07-19 14:04 | 4.0K | |
| T1704-super.mol2 | 2025-07-19 14:04 | 2.6K | |
| T2844-super.mol2 | 2025-07-19 14:04 | 4.1K | |
| T3376-super.mol2 | 2025-07-19 14:04 | 3.9K | |
| T3800-super.mol2 | 2025-07-19 14:04 | 6.4K | |
| T3824-super.mol2 | 2025-07-19 14:04 | 2.8K | |
| T5713-super.mol2 | 2025-07-19 14:04 | 5.4K | |
| T7781-super.mol2 | 2025-07-19 14:04 | 3.8K | |
| TN1041-super.mol2 | 2025-07-19 14:04 | 4.1K | |
| TN1113-super.mol2 | 2025-07-19 14:04 | 3.9K | |
| TN1291-super.mol2 | 2025-07-19 14:04 | 2.6K | |
| TN1877-super.mol2 | 2025-07-19 14:04 | 5.1K | |
| TN2010-super.mol2 | 2025-07-19 14:04 | 2.8K | |
| TN2011-super.mol2 | 2025-07-19 14:04 | 5.3K | |
| err | 2025-07-19 14:04 | 323 | |
| lbs_all_temp.log | 2025-07-19 14:04 | 56 | |
| log | 2025-07-19 14:04 | 54 | |
| lserr | 2025-07-19 14:00 | 0 | |
| mol2/ | 2025-07-19 14:03 | - | |
| out.txt | 2025-07-19 14:03 | 356 | |
| out_all.txt | 2025-07-19 14:04 | 1.0K | |
| py_error | 2025-07-19 14:04 | 3.8K | |
| py_log | 2025-07-19 14:04 | 30K | |
| q_Conformer3D_COMPOUND_CID_5280445-20250719110013.tar.gz | 2025-07-19 14:04 | 2.0K | |
| q_Conformer3D_COMPOUND_CID_5280445.mol | 2025-07-19 14:03 | 2.9K | |
| q_Conformer3D_COMPOUND_CID_5280445.mol2 | 2025-07-19 14:00 | 3.2K | |
| q_Conformer3D_COMPOUND_CID_5280445.sdf | 2025-07-19 13:59 | 5.8K | |
| q_Conformer3D_COMPOUND_CID_5280445.svg | 2025-07-19 14:04 | 4.3K | |
| status.txt | 2025-07-19 14:04 | 4 | |
| xlogp1.txt | 2025-07-19 14:04 | 523 | |
| xlogp2.txt | 2025-07-19 14:04 | 94 | |